INFO: Using directory: "1" INFO: Using existing c-file: ./SOLEIL_MARS.c INFO: Using existing binary: ./SOLEIL_MARS.out INFO: === Simulation 'SOLEIL_MARS' (/home/nexmap/pkwi/xTESTS/2023-12-20/McXtrace_CPU_MPICC_KISS_5e7/SOLEIL_MARS/SOLEIL_MARS.instr): running on 16 nodes (master is 'elearn1.fysik.dtu.dk', MPI version 3.1). SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Pt.dat' (Table_Read_Offset) SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize SOLEIL_MARS: Energy 16.99 [keV] Mono Angle 10.9544 [deg][SOLEIL_MARS] Initialize INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Si.txt' (Table_Read_Offset) Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/FormFactors.txt' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Reusing input file 'Si.txt' (Table_Read_Offset) Reusing input file 'FormFactors.txt' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Reusing input file 'Pt.dat' (Table_Read_Offset) INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/LaB6_660b_AVID2.hkl' (Table_Read_Offset) Table from file 'LaB6_660b_AVID2.hkl' (block 1) is 1453 x 6 (x=1:23), constant step. interpolation: linear '# TITLE La1 B6 [Cubic, Centric (-1 at origin)];# a b ...' PowderN: Sample: Reading 1453 rows from LaB6_660b_AVID2.hkl PowderN: Sample: Powder file probably of type Crystallographica/Fullprof (lau) WARNING: but F2 unit is set to barns=1 (barns). Intensity might be 100 times too high. PowderN: Sample: Read 1453 reflections from file 'LaB6_660b_AVID2.hkl' PowderN: Sample: WARNING: You have requested statistics for incoherent scattering but not set a material datafile ('NULL') nor defined sigma_inc! INFO (reflectivity-lib) reflectivity parameterization type: 'eth' INFO (reflectivity-lib) reflectivity parameterization type: 'eth' ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl ./SOLEIL_MARS.c: ERROR: can not open file LaB6_660b_AVID2.hkl -------------------------------------------------------------------------- Primary job terminated normally, but 1 process returned a non-zero exit code. Per user-direction, the job has been aborted. -------------------------------------------------------------------------- -------------------------------------------------------------------------- mpirun detected that one or more processes exited with non-zero status, thus causing the job to be terminated. The first process to do so was: Process name: [[48835,1],12] Exit code: 62 -------------------------------------------------------------------------- INFO: call to mpirun failed with Command 'mpirun -np 16 ./SOLEIL_MARS.out --seed 1000 --ncount 50000000.0 --dir 1 --format McCode E0=16.99' returned non-zero exit status 62. Traceback (most recent call last): File "/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/mxrun.py", line 562, in main() File "/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/mxrun.py", line 540, in main mcstas.run() # in mccode.py File "/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/mccode.py", line 275, in run return self.runMPI(args, pipe, override_mpi) File "/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/mccode.py", line 304, in runMPI return Process(binpath).run(args, pipe=pipe) File "/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/mccode.py", line 72, in run raise err File "/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/tools/Python/mxrun/mccode.py", line 68, in run proc = run(command, shell=True, check=True, text=True, capture_output=pipe) File "/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/miniconda3/lib/python3.10/subprocess.py", line 526, in run raise CalledProcessError(retcode, process.args, subprocess.CalledProcessError: Command 'mpirun -np 16 ./SOLEIL_MARS.out --seed 1000 --ncount 50000000.0 --dir 1 --format McCode E0=16.99' returned non-zero exit status 62.